methyl 2-methyl-1-[(4-methylphenyl)methyl]-5-oxidanylidene-4-[(4-prop-2-enoxyphenyl)methylidene]pyrrole-3-carboxylate

Systemtic Name: methyl 2-methyl-1-[(4-methylphenyl)methyl]-5-oxidanylidene-4-[(4-prop-2-enoxyphenyl)methylidene]pyrrole-3-carboxylate Openeye Name: methyl 4-[(4-allyloxyphenyl)methylene]-2-methyl-5-oxo-1-(p-tolylmethyl)pyrrole-3-carboxylate CAS Name: 2-methyl-1-[(4-methylphenyl)methyl]-5-oxo-4-[(4-prop-2-enoxyphenyl)methylidene]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-1-[(4-methylphenyl)methyl]-5-oxo-4-[(4-prop-2-enoxyphenyl)methylidene]pyrrole-3-carboxylate Traditional Name: 4-(4-allyloxybenzylidene)-5-keto-2-methyl-1-(4-methylbenzyl)-2-pyrroline-3-carboxylic acid methyl ester Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=CC3=CC=C(C=C3)OCC=C)C2=O)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=CC3=CC=C(C=C3)OCC=C)C2=O)C(=O)OC)C

InChI

InChI=1S/C25H25NO4/c1-5-14-30-21-12-10-19(11-13-21)15-22-23(25(28)29-4)18(3)26(24(22)27)16-20-8-6-17(2)7-9-20/h5-13,15H,1,14,16H2,2-4H3